Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02125819
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
Ligand | Ligand name | Chain | PDB | Tanimoto | Ligand in PDB |
---|---|---|---|---|---|
Ligand | Ligand name | Chain | PDB | Tanimoto | Ligand in PDB |
173 | BENZOYL-FORMIC ACID | A,B | 1SZE | 0.73 | |
3HP | 3-HYDROXYPHENYLACETATE | M,N,O,P,Q,R | 3PCE | 0.76 | |
3BZ | 3-chlorobenzoate | X | 2QVZ | 0.7 | |
3BZ | 3-chlorobenzoate | X | 2QVX | 0.7 | |
4HP | 4-HYDROXYPHENYLACETATE | A,B,C,D | 2JBT | 0.78 | |
4HP | 4-HYDROXYPHENYLACETATE | A | 2YYJ | 0.78 | |
4HP | 4-HYDROXYPHENYLACETATE | A | 2YYM | 0.78 | |
4HP | 4-HYDROXYPHENYLACETATE | B | 1AI6 | 0.78 | |
4HP | 4-HYDROXYPHENYLACETATE | M,N,O,P,Q,R | 3PCG | 0.78 | |
295 | (2S,3S)-3-(4-fluorophenyl)-2,3- dihydroxypropanoic acid | A,B | 2RJR | 0.81 | |
174 | 4-CHLORO-BENZOIC ACID | X | 3DLP | 0.7 | |
174 | 4-CHLORO-BENZOIC ACID | X | 1T5D | 0.7 | |
184 | 6-[HYDROXY-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRO-NAPHTALEN-2- YL)-METHYL]-NAPHTALENE-2-CARBOXYLIC ACID | A | 1FCX | 0.75 | |
156 | 4-[3-OXO-3-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRO-NAPHTHALEN-2- YL)-PROPENYL]-BENZOIC ACID | A | 1FCZ | 0.74 | |
2NA | naphthalen-2-ylmethanol | A,B,C | 3EE5 | 0.74 | |
3HB | 3-HYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCB | 0.75 | |
3HB | 3-HYDROXYBENZOIC ACID | A | 2DKH | 0.75 | |
4MA | 4-METHYLBENZOIC ACID | A,H | 2HRG | 0.79 | |
4CB | 4-CARBOXYPHENYLBORONIC ACID | A,B | 1KDW | 0.76 | |
2HC | (2E)-3-(2-HYDROXYPHENYL)ACRYLIC ACID | A,B | 1V5Z | 0.71 | |
564 | 6-(5,5,8,8-TETRAMETHYL-5,6,7,8- TETRAHYDRO-NAPHTALENE-2-CARBONYL)- NAPHTALENE-2-CARBOXYLIC ACID | A | 1FCY | 0.71 | |
269 | (1R)-3-chloro-1-phenylpropan-1- ol | A | 2RBS | 0.74 | |
4FC | A | 1YSG | 0.78 | ||
24B | (2,4-DIFLUOROPHENYL)METHANOL | A,B | 1QV6 | 0.71 | |
256 | PHENYL(SULFO)ACETIC ACID | A | 1O4Q | 0.7 | |
12M | (2-ETHYLPHENYL)METHANOL | A,B | 2F62 | 0.78 | |
26C | A,B | 2F7I | 0.77 |